N-[3-tert-butyl-1-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-N~2~-[(furan-2-yl)methyl]-N~2~-[(phenylsulfanyl)acetyl]glycinamide
Chemical Structure Depiction of
N-[3-tert-butyl-1-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-N~2~-[(furan-2-yl)methyl]-N~2~-[(phenylsulfanyl)acetyl]glycinamide
N-[3-tert-butyl-1-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-N~2~-[(furan-2-yl)methyl]-N~2~-[(phenylsulfanyl)acetyl]glycinamide
Compound characteristics
| Compound ID: | V027-5554 |
| Compound Name: | N-[3-tert-butyl-1-(3,4-dichlorophenyl)-1H-pyrazol-5-yl]-N~2~-[(furan-2-yl)methyl]-N~2~-[(phenylsulfanyl)acetyl]glycinamide |
| Molecular Weight: | 571.53 |
| Molecular Formula: | C28 H28 Cl2 N4 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1cc(NC(CN(Cc2ccco2)C(CSc2ccccc2)=O)=O)n(c2ccc(c(c2)[Cl])[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 6.9324 |
| logD: | 6.9309 |
| logSw: | -6.3098 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.984 |
| InChI Key: | UETURKBABLUWFO-UHFFFAOYSA-N |